Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8vq3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 2.A OE1 no hydrogen 3.334 N/A GLN 5.A N ARG 22.A O no hydrogen 2.899 N/A VAL 7.A N LYS 20.A O no hydrogen 2.838 N/A GLU 8.A N LYS 20.A O no hydrogen 3.325 N/A LYS 9.A NZ GLU 12.A OE1 no hydrogen 2.785 N/A ILE 10.A N VAL 18.A O no hydrogen 2.853 N/A GLY 11.A N VAL 18.A O no hydrogen 3.186 N/A GLY 13.A N GLY 16.A O no hydrogen 2.677 N/A GLY 16.A N GLY 13.A O no hydrogen 3.395 N/A VAL 18.A N GLY 11.A O no hydrogen 2.815 N/A TYR 19.A N LEU 32.A O no hydrogen 2.775 N/A LYS 20.A N GLU 8.A O no hydrogen 2.678 N/A ALA 21.A N VAL 30.A O no hydrogen 2.886 N/A ARG 22.A N GLN 5.A O no hydrogen 2.880 N/A ASN 23.A N GLU 28.A O no hydrogen 2.755 N/A LYS 24.A N ASN 3.A O no hydrogen 3.171 N/A LYS 24.A NZ GLU 2.A O no hydrogen 3.105 N/A LEU 25.A N ASN 3.A OD1 no hydrogen 3.354 N/A THR 26.A N ASN 23.A OD1 no hydrogen 2.898 N/A THR 26.A OG1 ASN 23.A OD1 no hydrogen 3.124 N/A THR 26.A OG1 GLU 28.A OE1 no hydrogen 2.361 N/A GLY 27.A N ASN 23.A O no hydrogen 2.617 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.057 N/A VAL 30.A N ALA 21.A O no hydrogen 2.889 N/A ALA 31.A N PHE 80.A O no hydrogen 2.787 N/A LEU 32.A N TYR 19.A O no hydrogen 2.755 N/A LYS 33.A N LEU 78.A O no hydrogen 2.785 N/A LYS 33.A NZ GLU 51.A OE1 no hydrogen 3.179 N/A LYS 34.A N VAL 17.A O no hydrogen 2.940 N/A LYS 34.A NZ TYR 77.A OH no hydrogen 2.781 N/A ILE 35.A N LEU 76.A O no hydrogen 2.800 N/A LEU 37.A N ASN 74.A O no hydrogen 2.754 N/A THR 39.A N ARG 36.A O no hydrogen 3.233 N/A GLU 40.A N LEU 37.A O no hydrogen 3.269 N/A THR 47.A OG1 GLY 147.A O no hydrogen 3.114 N/A ALA 48.A N PRO 45.A O no hydrogen 2.794 N/A ILE 49.A N PRO 45.A O no hydrogen 3.028 N/A ARG 50.A N SER 46.A O no hydrogen 3.039 N/A GLU 51.A N THR 47.A O no hydrogen 3.107 N/A ILE 52.A N ALA 48.A O no hydrogen 2.909 N/A SER 53.A N ILE 49.A O no hydrogen 3.030 N/A LEU 54.A N ARG 50.A O no hydrogen 2.931 N/A LEU 55.A N GLU 51.A O no hydrogen 2.948 N/A LYS 56.A N ILE 52.A O no hydrogen 3.072 N/A GLU 57.A N SER 53.A O no hydrogen 3.258 N/A GLU 57.A N LEU 54.A O no hydrogen 3.018 N/A LEU 58.A N LEU 54.A O no hydrogen 2.839 N/A ASN 62.A N HIS 60.A ND1 no hydrogen 2.937 N/A ASN 62.A ND2 GLN 110.A OE1 no hydrogen 3.177 N/A ASN 62.A ND2 ILE 141.A O no hydrogen 2.969 N/A ILE 63.A N HIS 60.A O no hydrogen 3.080 N/A VAL 64.A N LEU 143.A O no hydrogen 2.907 N/A LYS 65.A N GLU 81.A OE2 no hydrogen 2.640 N/A LYS 65.A NZ ASN 59.A OD1 no hydrogen 3.000 N/A LEU 67.A N VAL 79.A O no hydrogen 2.648 N/A ASP 68.A N VAL 79.A O no hydrogen 3.211 N/A VAL 69.A N ASP 68.A OD1 no hydrogen 2.721 N/A ILE 70.A N TYR 77.A O no hydrogen 2.857 N/A HIS 71.A ND1 LYS 75.A O no hydrogen 3.323 N/A THR 72.A N LYS 75.A O no hydrogen 2.953 N/A THR 72.A OG1 GLU 73.A O no hydrogen 3.129 N/A THR 72.A OG1 LYS 75.A O no hydrogen 3.458 N/A LYS 75.A NZ GLU 73.A O no hydrogen 2.685 N/A LEU 76.A N ILE 35.A O no hydrogen 2.861 N/A TYR 77.A N ILE 70.A O no hydrogen 2.811 N/A LEU 78.A N LYS 33.A O no hydrogen 2.806 N/A VAL 79.A N ASP 68.A O no hydrogen 2.950 N/A PHE 80.A N ALA 31.A O no hydrogen 2.776 N/A GLU 81.A N LYS 65.A O no hydrogen 3.111 N/A GLN 85.A N ILE 135.A O no hydrogen 3.481 N/A LEU 87.A N LEU 133.A O no hydrogen 2.712 N/A LYS 89.A N ASP 86.A OD1 no hydrogen 2.756 N/A PHE 90.A N ASP 86.A O no hydrogen 3.199 N/A MET 91.A N LEU 87.A O no hydrogen 2.944 N/A ASP 92.A N LYS 88.A O no hydrogen 2.961 N/A ALA 93.A N LYS 89.A O no hydrogen 2.965 N/A SER 94.A N PHE 90.A O no hydrogen 3.016 N/A SER 94.A N MET 91.A O no hydrogen 3.103 N/A SER 94.A OG PHE 90.A O no hydrogen 2.736 N/A ALA 95.A N ASP 92.A O no hydrogen 3.191 N/A THR 97.A OG1 GLY 98.A O no hydrogen 3.383 N/A GLY 98.A N SER 94.A O no hydrogen 2.600 N/A LEU 103.A N PRO 100.A O no hydrogen 2.815 N/A ILE 104.A N PRO 100.A O no hydrogen 3.005 N/A LYS 105.A N LEU 101.A O no hydrogen 2.899 N/A LYS 105.A NZ PHE 284.A O no hydrogen 2.917 N/A SER 106.A N PRO 102.A O no hydrogen 3.051 N/A TYR 107.A N LEU 103.A O no hydrogen 2.843 N/A LEU 108.A N ILE 104.A O no hydrogen 2.946 N/A PHE 109.A N LYS 105.A O no hydrogen 2.926 N/A GLN 110.A N SER 106.A O no hydrogen 3.069 N/A GLN 110.A NE2 SER 106.A O no hydrogen 3.363 N/A GLN 110.A NE2 SER 106.A OG no hydrogen 3.043 N/A GLN 110.A NE2 GLY 139.A O no hydrogen 2.939 N/A LEU 111.A N TYR 107.A O no hydrogen 2.836 N/A LEU 112.A N LEU 108.A O no hydrogen 2.942 N/A GLN 113.A N PHE 109.A O no hydrogen 2.957 N/A GLY 114.A N GLN 110.A O no hydrogen 3.041 N/A LEU 115.A N LEU 111.A O no hydrogen 2.903 N/A ALA 116.A N LEU 112.A O no hydrogen 2.789 N/A PHE 117.A N GLN 113.A O no hydrogen 3.081 N/A CYS 118.A N GLY 114.A O no hydrogen 3.035 N/A CYS 118.A SG GLY 114.A O no hydrogen 3.355 N/A HIS 119.A N LEU 115.A O no hydrogen 2.805 N/A HIS 119.A NE2 ASP 184.A OD2 no hydrogen 3.014 N/A SER 120.A N ALA 116.A O no hydrogen 2.800 N/A SER 120.A OG ALA 116.A O no hydrogen 3.089 N/A HIS 121.A N PHE 117.A O no hydrogen 3.067 N/A HIS 121.A N CYS 118.A O no hydrogen 2.961 N/A ARG 122.A N HIS 119.A O no hydrogen 2.913 N/A VAL 123.A N CYS 118.A O no hydrogen 3.027 N/A LEU 124.A N ARG 150.A O no hydrogen 2.808 N/A HIS 125.A N ASP 184.A OD2 no hydrogen 2.823 N/A HIS 125.A NE2 ALA 144.A O no hydrogen 2.771 N/A ARG 126.A N ASP 184.A OD1 no hydrogen 2.778 N/A ARG 126.A NE LEU 148.A O no hydrogen 2.701 N/A ARG 126.A NH1 GLU 161.A OE1 no hydrogen 2.853 N/A ARG 126.A NH2 LEU 148.A O no hydrogen 2.805 N/A ARG 126.A NH2 GLU 161.A OE2 no hydrogen 3.156 N/A ASP 127.A N HIS 125.A ND1 no hydrogen 3.063 N/A ASN 132.A N LYS 129.A O no hydrogen 2.809 N/A ASN 132.A ND2 ASP 127.A O no hydrogen 2.954 N/A LEU 133.A N PRO 130.A O no hydrogen 3.268 N/A LEU 134.A N LYS 142.A O no hydrogen 3.003 N/A ILE 135.A N GLN 85.A O no hydrogen 2.800 N/A ASN 136.A N ALA 140.A O no hydrogen 3.214 N/A GLU 138.A N ASN 136.A OD1 no hydrogen 2.764 N/A ALA 140.A N ASN 136.A OD1 no hydrogen 3.080 N/A ILE 141.A N GLN 110.A OE1 no hydrogen 3.114 N/A LYS 142.A N LEU 134.A O no hydrogen 2.792 N/A LYS 142.A NZ GLU 81.A OE1 no hydrogen 2.950 N/A LYS 142.A NZ GLU 81.A OE2 no hydrogen 3.136 N/A LEU 143.A N ASN 62.A O no hydrogen 2.759 N/A ALA 144.A N ASN 132.A O no hydrogen 2.935 N/A GLY 147.A N ASP 145.A OD2 no hydrogen 3.472 N/A ALA 149.A N PHE 146.A O no hydrogen 3.120 N/A ARG 150.A N LEU 124.A O no hydrogen 2.975 N/A ARG 150.A NH1 GLY 147.A O no hydrogen 3.231 N/A ARG 150.A NH1 ALA 149.A O no hydrogen 2.679 N/A PHE 152.A N ARG 122.A O no hydrogen 2.850 N/A THR 158.A N LYS 177.A O no hydrogen 2.958 N/A THR 158.A OG1 CYS 176.A O no hydrogen 2.797 N/A GLU 161.A N TYR 159.A O no hydrogen 3.149 N/A TRP 166.A NE1 GLY 204.A O no hydrogen 2.785 N/A TYR 167.A N THR 164.A OG1 no hydrogen 3.265 N/A TYR 167.A OH GLU 194.A OE1 no hydrogen 2.664 N/A TYR 167.A OH GLU 194.A OE2 no hydrogen 3.404 N/A ARG 168.A N LEU 165.A O no hydrogen 3.058 N/A ARG 168.A NE THR 164.A O no hydrogen 2.619 N/A ARG 168.A NH1 GLU 207.A OE2 no hydrogen 3.281 N/A ARG 168.A NH2 VAL 163.A O no hydrogen 3.113 N/A ARG 168.A NH2 THR 164.A O no hydrogen 3.043 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.706 N/A ILE 172.A N ALA 169.A O no hydrogen 3.134 N/A LEU 173.A N ALA 169.A O no hydrogen 3.234 N/A LEU 174.A N PRO 170.A O no hydrogen 2.825 N/A GLY 175.A N ILE 172.A O no hydrogen 3.061 N/A CYS 176.A N GLU 171.A O no hydrogen 2.969 N/A CYS 176.A SG TYR 178.A O no hydrogen 3.414 N/A TYR 179.A N VAL 156.A O no hydrogen 2.736 N/A ALA 182.A N SER 180.A OG no hydrogen 2.931 N/A VAL 183.A N SER 180.A O no hydrogen 2.972 N/A ASP 184.A N THR 181.A O no hydrogen 3.026 N/A ILE 185.A N THR 181.A O no hydrogen 3.385 N/A TRP 186.A N ALA 182.A O no hydrogen 2.898 N/A SER 187.A N VAL 183.A O no hydrogen 3.184 N/A SER 187.A OG TYR 167.A O no hydrogen 3.009 N/A SER 187.A OG VAL 183.A O no hydrogen 3.135 N/A LEU 188.A N ASP 184.A O no hydrogen 3.045 N/A GLY 189.A N ILE 185.A O no hydrogen 2.852 N/A CYS 190.A N TRP 186.A O no hydrogen 2.978 N/A CYS 190.A SG TRP 186.A O no hydrogen 3.475 N/A ILE 191.A N SER 187.A O no hydrogen 2.988 N/A PHE 192.A N LEU 188.A O no hydrogen 2.798 N/A ALA 193.A N GLY 189.A O no hydrogen 3.020 N/A GLU 194.A N CYS 190.A O no hydrogen 2.904 N/A MET 195.A N ILE 191.A O no hydrogen 2.917 N/A VAL 196.A N PHE 192.A O no hydrogen 3.272 N/A VAL 196.A N ALA 193.A O no hydrogen 3.187 N/A THR 197.A N ALA 193.A O no hydrogen 2.974 N/A THR 197.A OG1 ALA 193.A O no hydrogen 3.102 N/A ARG 198.A N GLU 194.A O no hydrogen 2.635 N/A ARG 198.A NE ALA 95.A O no hydrogen 3.127 N/A ARG 198.A NH2 ALA 95.A O no hydrogen 3.067 N/A ARG 199.A N THR 197.A OG1 no hydrogen 3.264 N/A GLY 204.A N PHE 202.A O no hydrogen 3.022 N/A GLY 204.A N GLN 210.A OE1 no hydrogen 2.917 N/A ASP 205.A N ASP 209.A OD2 no hydrogen 2.831 N/A ASP 209.A N SER 206.A OG no hydrogen 2.946 N/A GLN 210.A N SER 206.A O no hydrogen 2.850 N/A GLN 210.A NE2 TRP 166.A O no hydrogen 3.409 N/A GLN 210.A NE2 PHE 202.A O no hydrogen 2.948 N/A LEU 211.A N GLU 207.A O no hydrogen 3.082 N/A PHE 212.A N ILE 208.A O no hydrogen 2.968 N/A ARG 213.A N ASP 209.A O no hydrogen 2.934 N/A ARG 213.A NE ASP 209.A OD2 no hydrogen 3.044 N/A ILE 214.A N GLN 210.A O no hydrogen 3.113 N/A PHE 215.A N LEU 211.A O no hydrogen 2.916 N/A ARG 216.A N PHE 212.A O no hydrogen 2.734 N/A THR 217.A N ARG 213.A O no hydrogen 3.250 N/A THR 217.A N ILE 214.A O no hydrogen 3.057 N/A THR 217.A OG1 ARG 213.A O no hydrogen 3.336 N/A LEU 218.A N ILE 214.A O no hydrogen 2.801 N/A GLY 219.A N PHE 215.A O no hydrogen 2.635 N/A THR 220.A N TRP 242.A O no hydrogen 3.052 N/A THR 220.A OG1 PRO 240.A O no hydrogen 2.530 N/A VAL 225.A N ASP 222.A OD1 no hydrogen 3.077 N/A TRP 226.A N ASP 222.A O no hydrogen 2.946 N/A GLY 228.A N GLU 223.A OE1 no hydrogen 2.610 N/A VAL 229.A N TRP 226.A O no hydrogen 3.116 N/A THR 230.A N GLU 223.A OE2 no hydrogen 2.922 N/A THR 230.A OG1 GLU 223.A OE2 no hydrogen 2.068 N/A SER 231.A N GLY 228.A O no hydrogen 2.799 N/A MET 232.A N VAL 229.A O no hydrogen 3.003 N/A ASP 234.A N LEU 174.A O no hydrogen 3.085 N/A TYR 235.A N MET 232.A O no hydrogen 3.198 N/A LYS 236.A NZ PRO 233.A O no hydrogen 3.045 N/A LYS 236.A NZ TYR 235.A O no hydrogen 2.605 N/A PHE 239.A N LYS 236.A O no hydrogen 3.008 N/A LYS 241.A NZ PHE 239.A O no hydrogen 3.092 N/A TRP 242.A N THR 220.A OG1 no hydrogen 2.956 N/A GLN 245.A N THR 217.A O no hydrogen 2.894 N/A SER 248.A N ASP 246.A OD1 no hydrogen 3.137 N/A SER 248.A OG ASP 246.A OD1 no hydrogen 2.851 N/A SER 248.A OG ASP 246.A OD2 no hydrogen 2.682 N/A LYS 249.A N ASP 246.A O no hydrogen 3.129 N/A VAL 250.A N ASP 246.A O no hydrogen 3.235 N/A VAL 251.A N PHE 247.A O no hydrogen 3.010 N/A LEU 254.A N VAL 251.A O no hydrogen 3.197 N/A GLY 258.A N ASP 255.A OD1 no hydrogen 2.846 N/A ARG 259.A N ASP 255.A O no hydrogen 2.818 N/A SER 260.A N GLU 256.A O no hydrogen 2.868 N/A SER 260.A OG HIS 282.A NE2 no hydrogen 2.703 N/A LEU 261.A N ASP 257.A O no hydrogen 3.072 N/A LEU 262.A N GLY 258.A O no hydrogen 3.036 N/A SER 263.A N ARG 259.A O no hydrogen 3.078 N/A SER 263.A OG ARG 259.A O no hydrogen 2.583 N/A GLN 264.A N SER 260.A O no hydrogen 3.160 N/A GLN 264.A NE2 SER 260.A O no hydrogen 3.668 N/A MET 265.A N LEU 261.A O no hydrogen 2.837 N/A LEU 266.A N LEU 262.A O no hydrogen 2.921 N/A LEU 266.A N SER 263.A O no hydrogen 3.232 N/A HIS 267.A N GLN 264.A O no hydrogen 3.482 N/A TYR 268.A OH GLY 219.A O no hydrogen 2.539 N/A ASP 269.A N HIS 267.A ND1 no hydrogen 2.955 N/A ASN 271.A N ASP 269.A OD1 no hydrogen 2.936 N/A ASN 271.A ND2 ASP 269.A OD1 no hydrogen 3.520 N/A LYS 272.A N ASP 269.A O no hydrogen 2.881 N/A ARG 273.A N ASP 269.A O no hydrogen 2.874 N/A ARG 273.A NE HIS 267.A O no hydrogen 2.804 N/A ARG 273.A NH1 GLU 171.A OE1 no hydrogen 3.474 N/A ARG 273.A NH1 GLU 171.A OE2 no hydrogen 2.835 N/A ARG 273.A NH1 ALA 182.A O no hydrogen 2.961 N/A ARG 273.A NH2 GLU 171.A OE1 no hydrogen 2.774 N/A ARG 273.A NH2 HIS 267.A O no hydrogen 3.103 N/A ILE 274.A N GLN 264.A O no hydrogen 3.252 N/A ALA 278.A N SER 275.A OG no hydrogen 2.886 N/A ALA 279.A N SER 275.A O no hydrogen 2.849 N/A LEU 280.A N ALA 276.A O no hydrogen 3.198 N/A ALA 281.A N ALA 278.A O no hydrogen 2.915 N/A HIS 282.A N ALA 279.A O no hydrogen 3.019 N/A HIS 282.A NE2 SER 260.A OG no hydrogen 2.703 N/A PHE 284.A N HIS 282.A ND1 no hydrogen 2.895 N/A PHE 285.A N HIS 282.A O no hydrogen 2.973 N/A GLN 286.A N PRO 283.A O no hydrogen 3.167 N/A VAL 288.A N PHE 285.A O no hydrogen 3.199 N/A THR 289.A N PHE 285.A O no hydrogen 3.056 N/A